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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H16O4S
Molecular Weight 280.339
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ESONARIMOD, (S)-

SMILES

CC(=O)SC[C@@H](CC(=O)C1=CC=C(C)C=C1)C(O)=O

InChI

InChIKey=YRSSFEUQNAXQMX-GFCCVEGCSA-N
InChI=1S/C14H16O4S/c1-9-3-5-11(6-4-9)13(16)7-12(14(17)18)8-19-10(2)15/h3-6,12H,7-8H2,1-2H3,(H,17,18)/t12-/m1/s1

HIDE SMILES / InChI

Molecular Formula C14H16O4S
Molecular Weight 280.339
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:08:35 GMT 2023
Edited
by admin
on Sat Dec 16 09:08:35 GMT 2023
Record UNII
3R7V1R31PH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ESONARIMOD, (S)-
Common Name English
BENZENEBUTANOIC ACID, .ALPHA.-((ACETYLTHIO)METHYL)-4-METHYL-.GAMMA.-OXO-, (.ALPHA.S)-
Systematic Name English
(S)-KE-298
Common Name English
Code System Code Type Description
CAS
176107-73-6
Created by admin on Sat Dec 16 09:08:35 GMT 2023 , Edited by admin on Sat Dec 16 09:08:35 GMT 2023
PRIMARY
FDA UNII
3R7V1R31PH
Created by admin on Sat Dec 16 09:08:35 GMT 2023 , Edited by admin on Sat Dec 16 09:08:35 GMT 2023
PRIMARY
PUBCHEM
10221336
Created by admin on Sat Dec 16 09:08:35 GMT 2023 , Edited by admin on Sat Dec 16 09:08:35 GMT 2023
PRIMARY
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